N-(2-((6,7-dimethoxyisoquinolin-1-yl)methyl)-4,5-dimethoxyphenyl)-2-(hexyloxy)benzamide
TL;DR: N-(2-((6,7-dimethoxyisoquinolin-1-yl)methyl)-4,5-dimethoxyphenyl)-2-(hexyloxy)benzamide (CAS 858743-86-9) is a chemical compound with molecular formula C33H38N2O6 and molecular weight 558.27 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-[(6,7-dimethoxyisoquinolin-1-yl)methyl]-4,5-dimethoxyphenyl]-2-hexoxybenzamide
Also Known As: N-(2-((6,7-dimethoxyisoquinolin-1-yl)methyl)-4,5-dimethoxyphenyl)-2-(hexyloxy)benzamide, N-[2-[(6,7-dimethoxyisoquinolin-1-yl)methyl]-4,5-dimethoxy-phenyl]-2-hexoxy-benzamide, N-[2-[(6,7-dimethoxyisoquinolin-1-yl)methyl]-4,5-dimethoxyphenyl]-2-hexoxybenzamide, N-{2-[(6,7-dimethoxyisoquinolin-1-yl)methyl]-4,5-dimethoxyphenyl}-2-(hexyloxy)benzamide
| Molecular Formula | C33H38N2O6 |
|---|---|
| Molecular Weight | 558.27 g/mol |
| LogP | 7.0714 |
| Topological Polar Surface Area | 88.14 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 14 |
| Exact Mass | 558.273 |
| Heavy Atoms | 41 |
| Complexity | 1486.5652 |
Chemical Identifiers
| CAS Number | 858743-86-9 |
|---|---|
| SMILES | CCCCCCOC1=CC=CC=C1C(=O)NC2=CC(=C(C=C2CC3=NC=CC4=CC(=C(C=C43)OC)OC)OC)OC |
Product Overview
N-(2-((6,7-dimethoxyisoquinolin-1-yl)methyl)-4,5-dimethoxyphenyl)-2-(hexyloxy)benzamide (CAS 858743-86-9), with molecular formula C33H38N2O6 and molecular weight 558.27 g/mol. IUPAC: N-[2-[(6,7-dimethoxyisoquinolin-1-yl)methyl]-4,5-dimethoxyphenyl]-2-hexoxybenzamide.
Chemical Property Profile of N-(2-((6,7-dimethoxyisoquinolin-1-yl)methyl)-4,5-dimethoxyphenyl)-2-(hexyloxy)benzamide
Property Insights of N-(2-((6,7-dimethoxyisoquinolin-1-yl)methyl)-4,5-dimethoxyphenyl)-2-(hexyloxy)benzamide
The XLogP value of 7.0714 indicates that N-(2-((6,7-dimethoxyisoquinolin-1-yl)methyl)-4,5-dimethoxyphenyl)-2-(hexyloxy)benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 88.14 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(2-((6,7-dimethoxyisoquinolin-1-yl)methyl)-4,5-dimethoxyphenyl)-2-(hexyloxy)benzamide. Following Lipinski's Rule of Five, N-(2-((6,7-dimethoxyisoquinolin-1-yl)methyl)-4,5-dimethoxyphenyl)-2-(hexyloxy)benzamide has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-(2-((6,7-dimethoxyisoquinolin-1-yl)methyl)-4,5-dimethoxyphenyl)-2-(hexyloxy)benzamide?
The CAS number of N-(2-((6,7-dimethoxyisoquinolin-1-yl)methyl)-4,5-dimethoxyphenyl)-2-(hexyloxy)benzamide is 858743-86-9.
What is the molecular formula of N-(2-((6,7-dimethoxyisoquinolin-1-yl)methyl)-4,5-dimethoxyphenyl)-2-(hexyloxy)benzamide?
The molecular formula of N-(2-((6,7-dimethoxyisoquinolin-1-yl)methyl)-4,5-dimethoxyphenyl)-2-(hexyloxy)benzamide is C33H38N2O6.
What is the molecular weight of N-(2-((6,7-dimethoxyisoquinolin-1-yl)methyl)-4,5-dimethoxyphenyl)-2-(hexyloxy)benzamide?
The molecular weight of N-(2-((6,7-dimethoxyisoquinolin-1-yl)methyl)-4,5-dimethoxyphenyl)-2-(hexyloxy)benzamide is 558.27 g/mol.
Where can I buy N-(2-((6,7-dimethoxyisoquinolin-1-yl)methyl)-4,5-dimethoxyphenyl)-2-(hexyloxy)benzamide?
You can request a quote for N-(2-((6,7-dimethoxyisoquinolin-1-yl)methyl)-4,5-dimethoxyphenyl)-2-(hexyloxy)benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2-((6,7-dimethoxyisoquinolin-1-yl)methyl)-4,5-dimethoxyphenyl)-2-(hexyloxy)benzamide?
Yes, KEHONG BIO provides custom synthesis services for N-(2-((6,7-dimethoxyisoquinolin-1-yl)methyl)-4,5-dimethoxyphenyl)-2-(hexyloxy)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.